1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine

C21H15FN2O — CID 6407558

IUPAC1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine
SMILESFc1ccccc1COc1nnc(-c2ccccc2)c2ccccc12
InChIInChI=1S/C21H15FN2O/c22-19-13-7-4-10-16(19)14-25-21-18-12-6-5-11-17(18)20(23-24-21)15-8-2-1-3-9-15/h1-13H,14H2
InChIKeyLVXIAXAYIWMEFF-UHFFFAOYSA-N
MW330.36 g/mol
LogP5.01
Rot. Bonds4

About 1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine

1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine (PubChem CID 6407558) has the molecular formula C21H15FN2O and a molecular weight of 330.36 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine
PubChem CID6407558
Molecular FormulaC21H15FN2O
Molecular Weight330.36 g/mol
Exact Mass330.12
IUPAC Name1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine
SMILESFc1ccccc1COc1nnc(-c2ccccc2)c2ccccc12
InChIInChI=1S/C21H15FN2O/c22-19-13-7-4-10-16(19)14-25-21-18-12-6-5-11-17(18)20(23-24-21)15-8-2-1-3-9-15/h1-13H,14H2
InChIKeyLVXIAXAYIWMEFF-UHFFFAOYSA-N
XLogP5.01
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.36
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chlorophenyl)-4-ethoxyphthalazine
CID 6401671
1-(3-fluorophenoxy)-4-phenylphthalazine
CID 22011922
3-[(2-fluorophenyl)methoxy]pyridazine-4-carbonitrile
CID 80510980
2-chloro-3-[(2-fluorophenyl)methoxy]pyrazine
CID 63936130
N,N-dimethyl-4-(4-phenylmethoxyphthalazin-1-yl)benzamide
CID 23876950
[2-[(2-fluorophenyl)methoxy]-3-pyridinyl]methanamine
CID 63933252
1-fluoro-2-[(2-fluorophenyl)methoxymethyl]benzene
CID 67509440
2-chloro-4-[(2-fluorophenyl)methoxy]quinoline
CID 42597518
1-phenyl-4-(2,4,6-trimethylphenoxy)phthalazine
CID 154056698
4-[(2-fluorophenyl)methoxy]-5-iodopyrimidine
CID 66321208
2-[(2-fluorophenyl)methoxy]-6-methylpyridine-3-carbonitrile
CID 63937147
2-(chloromethyl)-5-[(2-fluorophenyl)methoxy]-1,3,4-oxadiazole
CID 23462320

Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine?
The IUPAC name of 1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine (CID 6407558) is 1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine.
What is the SMILES notation for 1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine?
The canonical SMILES for 1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine is Fc1ccccc1COc1nnc(-c2ccccc2)c2ccccc12.
What is the InChIKey of 1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine?
The InChIKey is LVXIAXAYIWMEFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15FN2O/c22-19-13-7-4-10-16(19)14-25-21-18-12-6-5-11-17(18)20(23-24-21)15-8-2-1-3-9-15/h1-13H,14H2.
What are the key properties of 1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine?
1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine has a molecular weight of 330.36 g/mol, XLogP of 5.01, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methoxy]-4-phenylphthalazine is sourced from PubChem (CID 6407558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).